N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9H-xanthene-9-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9H-xanthene-9-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-9H-xanthene-9-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9H-xanthene-9-carboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9H-xanthene-9-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-9H-xanthene-9-carboxamide Formula: C23H18N2O2S MolecularWeight: 386.46622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)C#N

InChI

InChI=1S/C23H18N2O2S/c24-13-17-14-7-3-6-12-20(14)28-23(17)25-22(26)21-15-8-1-4-10-18(15)27-19-11-5-2-9-16(19)21/h1-2,4-5,8-11,21H,3,6-7,12H2,(H,25,26)